methyl [5-(benzyloxy)-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate
Chemical Structure Depiction of
methyl [5-(benzyloxy)-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate
methyl [5-(benzyloxy)-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate
Compound characteristics
| Compound ID: | Y040-3518 |
| Compound Name: | methyl [5-(benzyloxy)-4,7-dimethyl-2-oxo-2H-1-benzopyran-3-yl]acetate |
| Molecular Weight: | 352.39 |
| Molecular Formula: | C21 H20 O5 |
| Smiles: | CC1=C(CC(=O)OC)C(=O)Oc2cc(C)cc(c12)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.2567 |
| logD: | 4.2567 |
| logSw: | -4.8069 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.053 |
| InChI Key: | XSDICLHUFBVINT-UHFFFAOYSA-N |